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canSAR790991
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NAMES
    SMILES
    CCC[C@H]1c2ccccc2[C@H]2C[C@@]12c1c[nH]cn1
    InChI
    InChI=1S/C16H18N2/c1-2-5-13-11-6-3-4-7-12(11)14-8-16(13,14)15-9-17-10-18-15/h3-4,6-7,9-10,13-14H,2,5,8H2,1H3,(H,17,18)/t13-,14+,16+/m0/s1
    MOLECULAR FORMULA
    C16H18N2
    CROSS REFERENCES
    790991 logo

    canSAR790991

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 238.15
    AlogP 3.73
    HBond donors 1
    HBond acceptors 2
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR790991.